[(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane

C16H34OSi — CID 58902915

IUPAC[(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane
SMILESC/C=C(\C)C[C@H](C)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34OSi/c1-10-15(8)11-16(9)17-18(12(2)3,13(4)5)14(6)7/h10,12-14,16H,11H2,1-9H3/b15-10+/t16-/m0/s1
InChIKeyFPDFDOWLTHIPDS-KMPOOHAWSA-N
MW270.53 g/mol
LogP5.92
Rot. Bonds7

About [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane

[(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane (PubChem CID 58902915) has the molecular formula C16H34OSi and a molecular weight of 270.53 g/mol. Its IUPAC name is [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane
PubChem CID58902915
Molecular FormulaC16H34OSi
Molecular Weight270.53 g/mol
Exact Mass270.24
IUPAC Name[(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane
SMILESC/C=C(\C)C[C@H](C)O[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C16H34OSi/c1-10-15(8)11-16(9)17-18(12(2)3,13(4)5)14(6)7/h10,12-14,16H,11H2,1-9H3/b15-10+/t16-/m0/s1
InChIKeyFPDFDOWLTHIPDS-KMPOOHAWSA-N
XLogP5.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.53
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane (CID 58902915) is [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane is C/C=C(\C)C[C@H](C)O[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane?
The InChIKey is FPDFDOWLTHIPDS-KMPOOHAWSA-N. The full InChI is InChI=1S/C16H34OSi/c1-10-15(8)11-16(9)17-18(12(2)3,13(4)5)14(6)7/h10,12-14,16H,11H2,1-9H3/b15-10+/t16-/m0/s1.
What are the key properties of [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane?
[(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 270.53 g/mol, XLogP of 5.92, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,2S)-4-methylhex-4-en-2-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 58902915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).